N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
TL;DR: N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine (CAS 7403-20-5) is a chemical compound with molecular formula C8H11N5S and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
Also Known As: N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine, N-Butyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
| Molecular Formula | C8H11N5S |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.07352 |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 7403-20-5 |
|---|---|
| SMILES | CCCCNC1=NC=NC2=NSN=C21 |
| InChIKey | RVGLURHZGYFDIV-UHFFFAOYSA-N |
Product Overview
N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine (CAS 7403-20-5), with molecular formula C8H11N5S and molecular weight 209.07 g/mol. IUPAC: N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine.
Chemical Property Profile of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
Property Insights of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine. Following Lipinski's Rule of Five, N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine?
The CAS number of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine is 7403-20-5.
What is the molecular formula of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine?
The molecular formula of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine is C8H11N5S.
What is the molecular weight of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine?
The molecular weight of N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine is 209.07 g/mol.
Where can I buy N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine?
You can request a quote for N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.